1-(azepan-1-yl)-2-{3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2,5-dimethyl-1H-pyrrol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2,5-dimethyl-1H-pyrrol-1-yl}ethan-1-one
1-(azepan-1-yl)-2-{3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2,5-dimethyl-1H-pyrrol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | M956-1350 |
| Compound Name: | 1-(azepan-1-yl)-2-{3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2,5-dimethyl-1H-pyrrol-1-yl}ethan-1-one |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C22 H25 F N4 O2 |
| Smiles: | Cc1cc(c(C)n1CC(N1CCCCCC1)=O)c1nc(c2ccc(cc2)F)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.2294 |
| logD: | 4.2294 |
| logSw: | -4.1821 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.289 |
| InChI Key: | VTVKMHQWNKICGG-UHFFFAOYSA-N |